| SpectraBase Compound ID | 6hn3sdsChQP |
|---|---|
| InChI | InChI=1S/C8H5ClN2O6/c1-17-8(12)4-2-5(10(13)14)7(9)6(3-4)11(15)16/h2-3H,1H3 |
| InChIKey | YJUFTUQWRBJBJN-UHFFFAOYSA-N |
| Mol Weight | 260.59 g/mol |
| Molecular Formula | C8H5ClN2O6 |
| Exact Mass | 259.983614 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3uQpe3TmVZb |
|---|---|
| Name | 4-chloro-3,5-dinitrobenzoic acid, methyl ester |
| Source of Sample | Aldrich Chemical Company, Inc., Milwaukee, Wisconsin |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H5ClN2O6 |
| InChI | InChI=1S/C8H5ClN2O6/c1-17-8(12)4-2-5(10(13)14)7(9)6(3-4)11(15)16/h2-3H,1H3 |
| InChIKey | YJUFTUQWRBJBJN-UHFFFAOYSA-N |
| Instrument Name | Varian A-60 |
| Sadtler NMR Number | 2273M |
| Solvent | CDCl3 |
| Synonyms | BENZOIC ACID, 4-CHLORO-3,5- DINITRO-, METHYL ESTER |